6-(3-Phenylpiperazin-1-yl)nicotinic acid
TL;DR: 6-(3-Phenylpiperazin-1-yl)nicotinic acid (CAS 904816-46-2) is a chemical compound with molecular formula C16H17N3O2 and molecular weight 283.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-phenylpiperazin-1-yl)pyridine-3-carboxylic acid
Also Known As: 6-(3-Phenylpiperazin-1-yl)nicotinic acid, 6-(3-phenylpiperazin-1-yl)pyridine-3-carboxylic Acid, 6-(3-PHENYL-PIPERAZIN-1-YL)-NICOTINIC ACID, 6-(3-Phenylpiperazin-1-yl)nicotinicacid, N/A
| Molecular Formula | C16H17N3O2 |
|---|---|
| Molecular Weight | 283.13 g/mol |
| LogP | 1.9307 |
| Topological Polar Surface Area | 65.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.13208 |
| Heavy Atoms | 21 |
| Complexity | 613.179 |
Chemical Identifiers
| CAS Number | 904816-46-2 |
|---|---|
| SMILES | C1CN(CC(N1)C2=CC=CC=C2)C3=NC=C(C=C3)C(=O)O |
Product Overview
6-(3-Phenylpiperazin-1-yl)nicotinic acid (CAS 904816-46-2), with molecular formula C16H17N3O2 and molecular weight 283.13 g/mol. IUPAC: 6-(3-phenylpiperazin-1-yl)pyridine-3-carboxylic acid.
Chemical Property Profile of 6-(3-Phenylpiperazin-1-yl)nicotinic acid
Property Insights of 6-(3-Phenylpiperazin-1-yl)nicotinic acid
The XLogP value of 1.9307 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(3-Phenylpiperazin-1-yl)nicotinic acid. The TPSA of 65.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(3-Phenylpiperazin-1-yl)nicotinic acid. Following Lipinski's Rule of Five, 6-(3-Phenylpiperazin-1-yl)nicotinic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(3-Phenylpiperazin-1-yl)nicotinic acid?
The CAS number of 6-(3-Phenylpiperazin-1-yl)nicotinic acid is 904816-46-2.
What is the molecular formula of 6-(3-Phenylpiperazin-1-yl)nicotinic acid?
The molecular formula of 6-(3-Phenylpiperazin-1-yl)nicotinic acid is C16H17N3O2.
What is the molecular weight of 6-(3-Phenylpiperazin-1-yl)nicotinic acid?
The molecular weight of 6-(3-Phenylpiperazin-1-yl)nicotinic acid is 283.13 g/mol.
Where can I buy 6-(3-Phenylpiperazin-1-yl)nicotinic acid?
You can request a quote for 6-(3-Phenylpiperazin-1-yl)nicotinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3-Phenylpiperazin-1-yl)nicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-(3-Phenylpiperazin-1-yl)nicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.